CAS RN: 65582-53-8
Europine N-oxide
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260613 | 5mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS65582-53-8
- Purity/Analytical Methods: >99.0%
65582-53-8 / (7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl)methyl 2,3-dihydroxy-2-(1-methoxyethyl)-3-methylbutanoate
Basic Information
CAS
65582-53-8
Multi CAS
Yes
Molecular Formula
C16H27NO7
Molecular Weight
345.390000
Exact Mass
345.178752
InChI
InChI=1S/C16H27NO7/c1-10(23-4)16(21,15(2,3)20)14(19)24-9-11-5-7-17(22)8-6-12(18)13(11)17/h5,10,12-13,18,20-21H,6-9H2,1-4H3
InChIKey
UPYLKTQCLCBJQP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Fraction Csp3
0.81
Rotatable bonds
6
H-bond acceptors
7
H-bond donors
3
Molar refractivity
84.53
TPSA
119.28
LogP / Solubility
WLOGP
-0.55
MLOGP
-0.46
XLogP3
-1.9
Consensus LogP
-0.97
Log S (ESOL)
-1.24
Class (ESOL)
Soluble
Log S (Ali)
-2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.17
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
5
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